diethyl 5-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido]-3-methylthiophene-2,4-dicarboxylate
diethyl 5-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 5486-0033 |
| Compound Name: | diethyl 5-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 472.52 |
| Molecular Formula: | C23 H24 N2 O7 S |
| Smiles: | [H]N(C(CCCN1C(c2ccccc2C1=O)=O)=O)c1c(C(=O)OCC)c(C)c(C(=O)OCC)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.5721 |
| logD: | 0.4259 |
| logSw: | -3.0912 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.921 |
| InChI Key: | OKKTUSFIJZPROY-UHFFFAOYSA-N |